! Pwscf input file created with ciftopw.py 
! Compound: Os(SCl6)2
&control
         calculation     = 'bands'
         prefix          = 'OsxSCl6x2'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           15.6416295231170324
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =            0.2540563922008244
         celldm(5)       =            0.2540563922008244
         celldm(6)       =            0.2540563922008244
         nat             =       15
         ntyp            =        3
         ecutwfc         =       55.00000000
         ecutrho         =      270.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-05 
         mixing_beta     =        3.00000000e-01    
   /
ATOMIC_SPECIES
 S  32.0650 S.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Cl  35.4530 Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Os 190.2300 Os.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
164
      0.00000000       0.00000000       0.00000000 1.0 
      0.02380952       0.00000000      -0.00000000 1.0 
      0.04761905       0.00000000      -0.00000000 1.0 
      0.07142857       0.00000000      -0.00000000 1.0 
      0.09523810       0.00000000      -0.00000000 1.0 
      0.11904762      -0.00000000      -0.00000000 1.0 
      0.14285714       0.00000000      -0.00000000 1.0 
      0.16666667      -0.00000000      -0.00000000 1.0 
      0.19047619       0.00000000      -0.00000000 1.0 
      0.21428571       0.00000000       0.00000000 1.0 
      0.23809524      -0.00000000      -0.00000000 1.0 
      0.26190476       0.00000000      -0.00000000 1.0 
      0.28571429       0.00000000      -0.00000000 1.0 
      0.30952381       0.00000000       0.00000000 1.0 
      0.33333333      -0.00000000      -0.00000000 1.0 
      0.35714286       0.00000000       0.00000000 1.0 
      0.38095238       0.00000000      -0.00000000 1.0 
      0.40476190       0.00000000      -0.00000000 1.0 
      0.42857143       0.00000000       0.00000000 1.0 
      0.45238095      -0.00000000      -0.00000000 1.0 
      0.47619048      -0.00000000      -0.00000000 1.0 
      0.50000000       0.00000000      -0.00000000 1.0 
      0.50000000       0.00000000      -0.00000000 1.0 
      0.50000000       0.01578763      -0.01578763 1.0 
      0.50000000       0.03157526      -0.03157526 1.0 
      0.50000000       0.04736288      -0.04736288 1.0 
      0.50000000       0.06315051      -0.06315051 1.0 
      0.50000000       0.07893814      -0.07893814 1.0 
      0.50000000       0.09472577      -0.09472577 1.0 
      0.50000000       0.11051340      -0.11051340 1.0 
      0.50000000       0.12630102      -0.12630102 1.0 
      0.50000000       0.14208865      -0.14208865 1.0 
      0.50000000       0.15787628      -0.15787628 1.0 
      0.50000000       0.17366391      -0.17366391 1.0 
      0.50000000       0.18945154      -0.18945154 1.0 
      0.50000000       0.20523917      -0.20523917 1.0 
      0.50000000       0.22102679      -0.22102679 1.0 
      0.50000000       0.23681442      -0.23681442 1.0 
      0.50000000       0.25260205      -0.25260205 1.0 
      0.50000000       0.26838968      -0.26838968 1.0 
      0.50000000       0.28417731      -0.28417731 1.0 
      0.50000000       0.29996493      -0.29996493 1.0 
      0.50000000       0.31575256      -0.31575256 1.0 
      0.50000000       0.33154019      -0.33154019 1.0 
      0.66845981       0.50000000       0.33154019 1.0 
      0.65314528       0.50000000       0.34685472 1.0 
      0.63783075       0.50000000       0.36216925 1.0 
      0.62251623       0.50000000       0.37748377 1.0 
      0.60720170       0.50000000       0.39279830 1.0 
      0.59188717       0.50000000       0.40811283 1.0 
      0.57657264       0.50000000       0.42342736 1.0 
      0.56125811       0.50000000       0.43874189 1.0 
      0.54594358       0.50000000       0.45405642 1.0 
      0.53062906       0.50000000       0.46937094 1.0 
      0.51531453       0.50000000       0.48468547 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48148148       0.48148148       0.48148148 1.0 
      0.46296296       0.46296296       0.46296296 1.0 
      0.44444444       0.44444444       0.44444444 1.0 
      0.42592593       0.42592593       0.42592593 1.0 
      0.40740741       0.40740741       0.40740741 1.0 
      0.38888889       0.38888889       0.38888889 1.0 
      0.37037037       0.37037037       0.37037037 1.0 
      0.35185185       0.35185185       0.35185185 1.0 
      0.33333333       0.33333333       0.33333333 1.0 
      0.31481481       0.31481481       0.31481481 1.0 
      0.29629630       0.29629630       0.29629630 1.0 
      0.27777778       0.27777778       0.27777778 1.0 
      0.25925926       0.25925926       0.25925926 1.0 
      0.24074074       0.24074074       0.24074074 1.0 
      0.22222222       0.22222222       0.22222222 1.0 
      0.20370370       0.20370370       0.20370370 1.0 
      0.18518519       0.18518519       0.18518519 1.0 
      0.16666667       0.16666667       0.16666667 1.0 
      0.14814815       0.14814815       0.14814815 1.0 
      0.12962963       0.12962963       0.12962963 1.0 
      0.11111111       0.11111111       0.11111111 1.0 
      0.09259259       0.09259259       0.09259259 1.0 
      0.07407407       0.07407407       0.07407407 1.0 
      0.05555556       0.05555556       0.05555556 1.0 
      0.03703704       0.03703704       0.03703704 1.0 
      0.01851852       0.01851852       0.01851852 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.01599116       0.00000000      -0.01599116 1.0 
      0.03198232       0.00000000      -0.03198232 1.0 
      0.04797347       0.00000000      -0.04797347 1.0 
      0.06396463       0.00000000      -0.06396463 1.0 
      0.07995579       0.00000000      -0.07995579 1.0 
      0.09594695       0.00000000      -0.09594695 1.0 
      0.11193810       0.00000000      -0.11193810 1.0 
      0.12792926       0.00000000      -0.12792926 1.0 
      0.14392042      -0.00000000      -0.14392042 1.0 
      0.15991158       0.00000000      -0.15991158 1.0 
      0.17590273      -0.00000000      -0.17590273 1.0 
      0.19189389       0.00000000      -0.19189389 1.0 
      0.20788505       0.00000000      -0.20788505 1.0 
      0.22387621       0.00000000      -0.22387621 1.0 
      0.23986736       0.00000000      -0.23986736 1.0 
      0.25585852       0.00000000      -0.25585852 1.0 
      0.27184968       0.00000000      -0.27184968 1.0 
      0.28784084      -0.00000000      -0.28784084 1.0 
      0.30383199       0.00000000      -0.30383199 1.0 
      0.31982315       0.00000000      -0.31982315 1.0 
      0.33581431       0.00000000      -0.33581431 1.0 
      0.35180547      -0.00000000      -0.35180547 1.0 
      0.36779662      -0.00000000      -0.36779662 1.0 
      0.38378778       0.00000000      -0.38378778 1.0 
      0.39977894      -0.00000000      -0.39977894 1.0 
      0.41577010       0.00000000      -0.41577010 1.0 
      0.58422990       0.41577010      -0.00000000 1.0 
      0.57019159       0.42980841      -0.00000000 1.0 
      0.55615327       0.44384673      -0.00000000 1.0 
      0.54211495       0.45788505      -0.00000000 1.0 
      0.52807663       0.47192337      -0.00000000 1.0 
      0.51403832       0.48596168      -0.00000000 1.0 
      0.50000000       0.50000000      -0.00000000 1.0 
      0.50000000       0.50000000      -0.00000000 1.0 
      0.50647922       0.50647922       0.02550309 1.0 
      0.51295845       0.51295845       0.05100618 1.0 
      0.51943767       0.51943767       0.07650927 1.0 
      0.52591689       0.52591689       0.10201237 1.0 
      0.53239612       0.53239612       0.12751546 1.0 
      0.53887534       0.53887534       0.15301855 1.0 
      0.54535456       0.54535456       0.17852164 1.0 
      0.55183379       0.55183379       0.20402473 1.0 
      0.55831301       0.55831301       0.22952782 1.0 
      0.56479223       0.56479223       0.25503092 1.0 
      0.57127146       0.57127146       0.28053401 1.0 
      0.57775068       0.57775068       0.30603710 1.0 
      0.58422990       0.58422990       0.33154019 1.0 
      0.58422990       0.58422990       0.33154019 1.0 
      0.57580691       0.57580691       0.34838617 1.0 
      0.56738392       0.56738392       0.36523215 1.0 
      0.55896093       0.55896093       0.38207813 1.0 
      0.55053794       0.55053794       0.39892411 1.0 
      0.54211495       0.54211495       0.41577010 1.0 
      0.53369196       0.53369196       0.43261608 1.0 
      0.52526897       0.52526897       0.44946206 1.0 
      0.51684598       0.51684598       0.46630804 1.0 
      0.50842299       0.50842299       0.48315402 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.00000000      -0.00000000 1.0 
      0.50842299       0.02078850       0.02078850 1.0 
      0.51684598       0.04157701       0.04157701 1.0 
      0.52526897       0.06236551       0.06236551 1.0 
      0.53369196       0.08315402       0.08315402 1.0 
      0.54211495       0.10394252       0.10394252 1.0 
      0.55053794       0.12473103       0.12473103 1.0 
      0.55896093       0.14551953       0.14551953 1.0 
      0.56738392       0.16630804       0.16630804 1.0 
      0.57580691       0.18709654       0.18709654 1.0 
      0.58422990       0.20788505       0.20788505 1.0 
      0.59265290       0.22867355       0.22867355 1.0 
      0.60107589       0.24946206       0.24946206 1.0 
      0.60949888       0.27025056       0.27025056 1.0 
      0.61792187       0.29103907       0.29103907 1.0 
      0.62634486       0.31182757       0.31182757 1.0 
      0.63476785       0.33261608       0.33261608 1.0 
      0.64319084       0.35340458       0.35340458 1.0 
      0.65161383       0.37419309       0.37419309 1.0 
      0.66003682       0.39498159       0.39498159 1.0 
      0.66845981       0.41577010       0.41577010 1.0 

